3-azanyl-4-[[ethanoyl-[4-[(2-hydroxyphenyl)carbamoylamino]-3-methoxy-phenyl]amino]-pyrrolidin-2-yl-methoxy]benzoic acid

Systemtic Name: 3-azanyl-4-[[ethanoyl-[4-[(2-hydroxyphenyl)carbamoylamino]-3-methoxy-phenyl]amino]-pyrrolidin-2-yl-methoxy]benzoic acid Openeye Name: 4-[[N-acetyl-4-[(2-hydroxyphenyl)carbamoylamino]-3-methoxy-anilino]-pyrrolidin-2-yl-methoxy]-3-amino-benzoic acid CAS Name: 4-[[N-acetyl-4-[[(2-hydroxyanilino)-oxomethyl]amino]-3-methoxyanilino]-(2-pyrrolidinyl)methoxy]-3-aminobenzoic acid IUPAC Name: 4-[[N-acetyl-4-[(2-hydroxyphenyl)carbamoylamino]-3-methoxyanilino]-pyrrolidin-2-ylmethoxy]-3-aminobenzoic acid Traditional Name: 4-[[N-acetyl-4-[(2-hydroxyphenyl)carbamoylamino]-3-methoxy-anilino]-pyrrolidin-2-yl-methoxy]-3-amino-benzoic acid Formula: C28H31N5O7 MolecularWeight: 549.57504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC(=C(C=C1)NC(=O)NC2=CC=CC=C2O)OC)C(C3CCCN3)OC4=C(C=C(C=C4)C(=O)O)N

Isomeric SMILES

CC(=O)N(C1=CC(=C(C=C1)NC(=O)NC2=CC=CC=C2O)OC)C(C3CCCN3)OC4=C(C=C(C=C4)C(=O)O)N

InChI

InChI=1S/C28H31N5O7/c1-16(34)33(26(22-7-5-13-30-22)40-24-12-9-17(27(36)37)14-19(24)29)18-10-11-21(25(15-18)39-2)32-28(38)31-20-6-3-4-8-23(20)35/h3-4,6,8-12,14-15,22,26,30,35H,5,7,13,29H2,1-2H3,(H,36,37)(H2,31,32,38)