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

Systemtic Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(propan-2-ylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(isopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-[oxo-(propan-2-ylamino)methyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(propan-2-ylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(isopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazino]phenyl]-piperonylamide Formula: C29H32N4O5 MolecularWeight: 516.58818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(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/C29H32N4O5/c1-19(2)30-29(35)22-17-21(31-28(34)20-8-11-26-27(16-20)38-18-37-26)9-10-23(22)32-12-14-33(15-13-32)24-6-4-5-7-25(24)36-3/h4-11,16-17,19H,12-15,18H2,1-3H3,(H,30,35)(H,31,34)