2-[4-[3-[(2-azanyl-4-methoxycarbonyl-phenyl)amino]phenyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[3-[(2-azanyl-4-methoxycarbonyl-phenyl)amino]phenyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[3-(2-amino-4-methoxycarbonyl-anilino)phenyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[3-(2-amino-4-methoxycarbonylanilino)phenyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[3-(2-amino-4-methoxycarbonylanilino)phenyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[3-(2-amino-4-carbomethoxy-anilino)phenyl]piperazino]acetic acid Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCN(CC3)CC(=O)O)N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCN(CC3)CC(=O)O)N

InChI

InChI=1S/C20H24N4O4/c1-28-20(27)14-5-6-18(17(21)11-14)22-15-3-2-4-16(12-15)24-9-7-23(8-10-24)13-19(25)26/h2-6,11-12,22H,7-10,13,21H2,1H3,(H,25,26)