2-[[4-[(2-aminophenyl)carbamoyl]phenyl]methylcarbamoyl]-5-methoxy-benzoic acid

Systemtic Name: 2-[[4-[(2-aminophenyl)carbamoyl]phenyl]methylcarbamoyl]-5-methoxy-benzoic acid Openeye Name: 2-[[4-[(2-aminophenyl)carbamoyl]phenyl]methylcarbamoyl]-5-methoxy-benzoic acid CAS Name: 2-[[[4-[(2-aminoanilino)-oxomethyl]phenyl]methylamino]-oxomethyl]-5-methoxybenzoic acid IUPAC Name: 2-[[4-[(2-aminophenyl)carbamoyl]phenyl]methylcarbamoyl]-5-methoxybenzoic acid Traditional Name: 2-[[4-[(2-aminophenyl)carbamoyl]benzyl]carbamoyl]-5-methoxy-benzoic acid Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)C(=O)O

InChI

InChI=1S/C23H21N3O5/c1-31-16-10-11-17(18(12-16)23(29)30)22(28)25-13-14-6-8-15(9-7-14)21(27)26-20-5-3-2-4-19(20)24/h2-12H,13,24H2,1H3,(H,25,28)(H,26,27)(H,29,30)