2-[(3,4-dichlorophenyl)methylamino]-3-(2,3-dihydro-1H-inden-5-ylamino)-5-methoxy-benzoic acid

Systemtic Name: 2-[(3,4-dichlorophenyl)methylamino]-3-(2,3-dihydro-1H-inden-5-ylamino)-5-methoxy-benzoic acid Openeye Name: 2-[(3,4-dichlorophenyl)methylamino]-3-(indan-5-ylamino)-5-methoxy-benzoic acid CAS Name: 2-[(3,4-dichlorophenyl)methylamino]-3-(2,3-dihydro-1H-inden-5-ylamino)-5-methoxybenzoic acid IUPAC Name: 2-[(3,4-dichlorophenyl)methylamino]-3-(2,3-dihydro-1H-inden-5-ylamino)-5-methoxybenzoic acid Traditional Name: 2-[(3,4-dichlorobenzyl)amino]-3-(indan-5-ylamino)-5-methoxy-benzoic acid Formula: C24H22Cl2N2O3 MolecularWeight: 457.34908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(=O)O)NCC2=CC(=C(C=C2)Cl)Cl)NC3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC1=CC(=C(C(=C1)C(=O)O)NCC2=CC(=C(C=C2)Cl)Cl)NC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C24H22Cl2N2O3/c1-31-18-11-19(24(29)30)23(27-13-14-5-8-20(25)21(26)9-14)22(12-18)28-17-7-6-15-3-2-4-16(15)10-17/h5-12,27-28H,2-4,13H2,1H3,(H,29,30)