methanamine; 3-methoxy-4-[4-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-3-oxidanylidene-butoxy]benzoic acid

Systemtic Name: methanamine; 3-methoxy-4-[4-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-3-oxidanylidene-butoxy]benzoic acid Openeye Name: methanamine; 3-methoxy-4-[4-[3-methoxy-4-(o-tolylcarbamoylamino)phenyl]-3-oxo-butoxy]benzoic acid CAS Name: methanamine; 3-methoxy-4-[4-[3-methoxy-4-[[(2-methylanilino)-oxomethyl]amino]phenyl]-3-oxobutoxy]benzoic acid IUPAC Name: methanamine; 3-methoxy-4-[4-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]-3-oxobutoxy]benzoic acid Traditional Name: 4-[3-keto-4-[3-methoxy-4-(o-tolylcarbamoylamino)phenyl]butoxy]-3-methoxy-benzoic acid; methylamine Formula: C28H33N3O7 MolecularWeight: 523.57752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)CCOC3=C(C=C(C=C3)C(=O)O)OC)OC.CN

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)CCOC3=C(C=C(C=C3)C(=O)O)OC)OC.CN

InChI

InChI=1S/C27H28N2O7.CH5N/c1-17-6-4-5-7-21(17)28-27(33)29-22-10-8-18(15-24(22)34-2)14-20(30)12-13-36-23-11-9-19(26(31)32)16-25(23)35-3;1-2/h4-11,15-16H,12-14H2,1-3H3,(H,31,32)(H2,28,29,33);2H2,1H3