N,N-diethyl-4-[phenyl-(4-prop-2-enylpiperazin-1-yl)methyl]benzamide hydrochloride

Systemtic Name: N,N-diethyl-4-[phenyl-(4-prop-2-enylpiperazin-1-yl)methyl]benzamide hydrochloride Openeye Name: 4-[(4-allylpiperazin-1-yl)-phenyl-methyl]-N,N-diethyl-benzamide hydrochloride CAS Name: N,N-diethyl-4-[phenyl-(4-prop-2-enyl-1-piperazinyl)methyl]benzamide hydrochloride IUPAC Name: N,N-diethyl-4-[phenyl-(4-prop-2-enylpiperazin-1-yl)methyl]benzamide hydrochloride Traditional Name: 4-[(4-allylpiperazino)-phenyl-methyl]-N,N-diethyl-benzamide hydrochloride Formula: C25H34ClN3O MolecularWeight: 428.00996

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCN(CC3)CC=C.Cl

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCN(CC3)CC=C.Cl

InChI

InChI=1S/C25H33N3O.ClH/c1-4-16-26-17-19-28(20-18-26)24(21-10-8-7-9-11-21)22-12-14-23(15-13-22)25(29)27(5-2)6-3;/h4,7-15,24H,1,5-6,16-20H2,2-3H3;1H