N-[3-(butan-2-ylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(butan-2-ylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(sec-butylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[(butan-2-ylamino)-oxomethyl]-4-[4-(2-methoxyphenyl)-1-piperazinyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(butan-2-ylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[4-(2-methoxyphenyl)piperazino]-3-(sec-butylcarbamoyl)phenyl]-piperonylamide Formula: C30H34N4O5 MolecularWeight: 530.61476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C30H34N4O5/c1-4-20(2)31-30(36)23-18-22(32-29(35)21-9-12-27-28(17-21)39-19-38-27)10-11-24(23)33-13-15-34(16-14-33)25-7-5-6-8-26(25)37-3/h5-12,17-18,20H,4,13-16,19H2,1-3H3,(H,31,36)(H,32,35)