4-[(2-azanylidene-3-methoxycarbonyl-heptanoyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)amino]benzoic acid

Systemtic Name: 4-[(2-azanylidene-3-methoxycarbonyl-heptanoyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)amino]benzoic acid Openeye Name: 4-[(2-imino-3-methoxycarbonyl-heptanoyl)-tetralin-6-yl-amino]benzoic acid CAS Name: 4-[(2-imino-3-methoxycarbonyl-1-oxoheptyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)amino]benzoic acid IUPAC Name: 4-[(2-imino-3-methoxycarbonylheptanoyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)amino]benzoic acid Traditional Name: 4-[(3-carbomethoxy-2-imino-heptanoyl)-tetralin-6-yl-amino]benzoic acid Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=N)C(=O)N(C1=CC=C(C=C1)C(=O)O)C2=CC3=C(CCCC3)C=C2)C(=O)OC

Isomeric SMILES

CCCCC(C(=N)C(=O)N(C1=CC=C(C=C1)C(=O)O)C2=CC3=C(CCCC3)C=C2)C(=O)OC

InChI

InChI=1S/C26H30N2O5/c1-3-4-9-22(26(32)33-2)23(27)24(29)28(20-13-11-18(12-14-20)25(30)31)21-15-10-17-7-5-6-8-19(17)16-21/h10-16,22,27H,3-9H2,1-2H3,(H,30,31)