[6-bromanyl-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl] pentanoate

Systemtic Name: [6-bromanyl-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl] pentanoate Openeye Name: [6-bromo-3-[(2-methoxyphenyl)carbamoyl]-2-naphthyl] pentanoate CAS Name: pentanoic acid [6-bromo-3-[(2-methoxyanilino)-oxomethyl]-2-naphthalenyl] ester IUPAC Name: [6-bromo-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl] pentanoate Traditional Name: valeric acid [6-bromo-3-[(2-methoxyphenyl)carbamoyl]-2-naphthyl] ester Formula: C23H22BrNO4 MolecularWeight: 456.32908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=C(C=C2C=C(C=CC2=C1)Br)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCCCC(=O)OC1=C(C=C2C=C(C=CC2=C1)Br)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C23H22BrNO4/c1-3-4-9-22(26)29-21-14-15-10-11-17(24)12-16(15)13-18(21)23(27)25-19-7-5-6-8-20(19)28-2/h5-8,10-14H,3-4,9H2,1-2H3,(H,25,27)