1-(1,3-benzoxazol-2-yl)-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-[3-[4-(m-tolyl)piperazino]propyl]isonipecotamide Formula: C27H35N5O2 MolecularWeight: 461.5991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C27H35N5O2/c1-21-6-4-7-23(20-21)31-18-16-30(17-19-31)13-5-12-28-26(33)22-10-14-32(15-11-22)27-29-24-8-2-3-9-25(24)34-27/h2-4,6-9,20,22H,5,10-19H2,1H3,(H,28,33)