(3Z)-3-(1-azanylpentylidene)-1-methyl-1-phenyl-urea; 4-[(3-carboxy-2-oxidanyl-naphthalen-1-yl)methyl]-3-oxidanyl-naphthalene-2-carboxylic acid

Systemtic Name: (3Z)-3-(1-azanylpentylidene)-1-methyl-1-phenyl-urea; 4-[(3-carboxy-2-oxidanyl-naphthalen-1-yl)methyl]-3-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: (3Z)-3-(1-aminopentylidene)-1-methyl-1-phenyl-urea; 4-[(3-carboxy-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-naphthalene-2-carboxylic acid CAS Name: (3Z)-3-(1-aminopentylidene)-1-methyl-1-phenylurea; 4-[(3-carboxy-2-hydroxy-1-naphthalenyl)methyl]-3-hydroxy-2-naphthalenecarboxylic acid IUPAC Name: (3Z)-3-(1-aminopentylidene)-1-methyl-1-phenylurea; 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid Traditional Name: (3Z)-3-(1-aminopentylidene)-1-methyl-1-phenyl-urea; 4-[(3-carboxy-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-2-naphthoic acid Formula: C36H35N3O7 MolecularWeight: 621.679

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NC(=O)N(C)C1=CC=CC=C1)N.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O

Isomeric SMILES

CCCC/C(=N/C(=O)N(C)C1=CC=CC=C1)/N.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O

InChI

InChI=1S/C23H16O6.C13H19N3O/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;1-3-4-10-12(14)15-13(17)16(2)11-8-6-5-7-9-11/h1-10,24-25H,11H2,(H,26,27)(H,28,29);5-9H,3-4,10H2,1-2H3,(H2,14,15,17)