3-[[[2-[(4-aminophenyl)methyl]-3-azanyl-2-methyl-3-oxidanylidene-propanoyl]amino]methyl]-4-oxidanyl-benzoic acid

Systemtic Name: 3-[[[2-[(4-aminophenyl)methyl]-3-azanyl-2-methyl-3-oxidanylidene-propanoyl]amino]methyl]-4-oxidanyl-benzoic acid Openeye Name: 3-[[[3-amino-2-[(4-aminophenyl)methyl]-2-methyl-3-oxo-propanoyl]amino]methyl]-4-hydroxy-benzoic acid CAS Name: 3-[[[3-amino-2-[(4-aminophenyl)methyl]-2-methyl-1,3-dioxopropyl]amino]methyl]-4-hydroxybenzoic acid IUPAC Name: 3-[[[3-amino-2-[(4-aminophenyl)methyl]-2-methyl-3-oxopropanoyl]amino]methyl]-4-hydroxybenzoic acid Traditional Name: 3-[[[3-amino-2-(4-aminobenzyl)-3-keto-2-methyl-propanoyl]amino]methyl]-4-hydroxy-benzoic acid Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)N)(C(=O)N)C(=O)NCC2=C(C=CC(=C2)C(=O)O)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)N)(C(=O)N)C(=O)NCC2=C(C=CC(=C2)C(=O)O)O

InChI

InChI=1S/C19H21N3O5/c1-19(17(21)26,9-11-2-5-14(20)6-3-11)18(27)22-10-13-8-12(16(24)25)4-7-15(13)23/h2-8,23H,9-10,20H2,1H3,(H2,21,26)(H,22,27)(H,24,25)