N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-(4-pentanoylphenyl)benzamide

Systemtic Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-(4-pentanoylphenyl)benzamide Openeye Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-(4-pentanoylphenyl)benzamide CAS Name: N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]-3-methyl-4-[4-(1-oxopentyl)phenyl]benzamide IUPAC Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-(4-pentanoylphenyl)benzamide Traditional Name: N-[4-methoxy-3-(4-methylpiperazino)phenyl]-3-methyl-4-(4-valerylphenyl)benzamide Formula: C31H37N3O3 MolecularWeight: 499.64378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)N4CCN(CC4)C)C

Isomeric SMILES

CCCCC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)N4CCN(CC4)C)C

InChI

InChI=1S/C31H37N3O3/c1-5-6-7-29(35)24-10-8-23(9-11-24)27-14-12-25(20-22(27)2)31(36)32-26-13-15-30(37-4)28(21-26)34-18-16-33(3)17-19-34/h8-15,20-21H,5-7,16-19H2,1-4H3,(H,32,36)