4-[2-[(3-methoxy-3-oxidanylidene-propyl)carbamoyl]-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoate

Systemtic Name: 4-[2-[(3-methoxy-3-oxidanylidene-propyl)carbamoyl]-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoate Openeye Name: 4-[2-[(3-methoxy-3-oxo-propyl)carbamoyl]-5-(3-thienylmethoxy)phenoxy]-4-(o-tolyl)butanoate CAS Name: 4-[2-[[(3-methoxy-3-oxopropyl)amino]-oxomethyl]-5-(3-thiophenylmethoxy)phenoxy]-4-(2-methylphenyl)butanoate IUPAC Name: 4-[2-[(3-methoxy-3-oxopropyl)carbamoyl]-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoate Traditional Name: 4-[2-[(3-keto-3-methoxy-propyl)carbamoyl]-5-(3-thenyloxy)phenoxy]-4-(o-tolyl)butyrate Formula: C27H28NO7S- MolecularWeight: 510.57872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)[O-])OC2=C(C=CC(=C2)OCC3=CSC=C3)C(=O)NCCC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)[O-])OC2=C(C=CC(=C2)OCC3=CSC=C3)C(=O)NCCC(=O)OC

InChI

InChI=1S/C27H29NO7S/c1-18-5-3-4-6-21(18)23(9-10-25(29)30)35-24-15-20(34-16-19-12-14-36-17-19)7-8-22(24)27(32)28-13-11-26(31)33-2/h3-8,12,14-15,17,23H,9-11,13,16H2,1-2H3,(H,28,32)(H,29,30)/p-1