[3-[(3S)-4-(4-chlorophenyl)carbonyl-3-methyl-piperazin-1-yl]-3-oxidanylidene-propyl]-(2-methylpropyl)azanium

Systemtic Name: [3-[(3S)-4-(4-chlorophenyl)carbonyl-3-methyl-piperazin-1-yl]-3-oxidanylidene-propyl]-(2-methylpropyl)azanium Openeye Name: [3-[(3S)-4-(4-chlorobenzoyl)-3-methyl-piperazin-1-yl]-3-oxo-propyl]-isobutyl-ammonium CAS Name: [3-[(3S)-4-[(4-chlorophenyl)-oxomethyl]-3-methyl-1-piperazinyl]-3-oxopropyl]-(2-methylpropyl)ammonium IUPAC Name: [3-[(3S)-4-(4-chlorobenzoyl)-3-methylpiperazin-1-yl]-3-oxopropyl]-(2-methylpropyl)azanium Traditional Name: [3-[(3S)-4-(4-chlorobenzoyl)-3-methyl-piperazino]-3-keto-propyl]-isobutyl-ammonium Formula: C19H29ClN3O2+ MolecularWeight: 366.90546

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=O)CC[NH2+]CC(C)C

Isomeric SMILES

C[C@H]1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=O)CC[NH2+]CC(C)C

InChI

InChI=1S/C19H28ClN3O2/c1-14(2)12-21-9-8-18(24)22-10-11-23(15(3)13-22)19(25)16-4-6-17(20)7-5-16/h4-7,14-15,21H,8-13H2,1-3H3/p+1/t15-/m0/s1