3-azanyl-4-[1-[[3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxidanylidene-propyl]amino]ethoxy]benzoic acid

Systemtic Name: 3-azanyl-4-[1-[[3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxidanylidene-propyl]amino]ethoxy]benzoic acid Openeye Name: 3-amino-4-[1-[[3-[3-methoxy-4-(o-tolylcarbamoylamino)phenyl]-2-oxo-propyl]amino]ethoxy]benzoic acid CAS Name: 3-amino-4-[1-[[3-[3-methoxy-4-[[(2-methylanilino)-oxomethyl]amino]phenyl]-2-oxopropyl]amino]ethoxy]benzoic acid IUPAC Name: 3-amino-4-[1-[[3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxopropyl]amino]ethoxy]benzoic acid Traditional Name: 3-amino-4-[1-[[2-keto-3-[3-methoxy-4-(o-tolylcarbamoylamino)phenyl]propyl]amino]ethoxy]benzoic acid Formula: C27H30N4O6 MolecularWeight: 506.5503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)CNC(C)OC3=C(C=C(C=C3)C(=O)O)N)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)CNC(C)OC3=C(C=C(C=C3)C(=O)O)N)OC

InChI

InChI=1S/C27H30N4O6/c1-16-6-4-5-7-22(16)30-27(35)31-23-10-8-18(13-25(23)36-3)12-20(32)15-29-17(2)37-24-11-9-19(26(33)34)14-21(24)28/h4-11,13-14,17,29H,12,15,28H2,1-3H3,(H,33,34)(H2,30,31,35)