3-[(3-nitrophenyl)methyl]-1-piperidin-4-yl-1-prop-2-enyl-urea hydrochloride

Systemtic Name: 3-[(3-nitrophenyl)methyl]-1-piperidin-4-yl-1-prop-2-enyl-urea hydrochloride Openeye Name: 1-allyl-3-[(3-nitrophenyl)methyl]-1-(4-piperidyl)urea hydrochloride CAS Name: 3-[(3-nitrophenyl)methyl]-1-(4-piperidinyl)-1-prop-2-enylurea hydrochloride IUPAC Name: 3-[(3-nitrophenyl)methyl]-1-piperidin-4-yl-1-prop-2-enylurea hydrochloride Traditional Name: 1-allyl-3-(3-nitrobenzyl)-1-(4-piperidyl)urea hydrochloride Formula: C16H23ClN4O3 MolecularWeight: 354.83182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1CCNCC1)C(=O)NCC2=CC(=CC=C2)[N+](=O)[O-].Cl

Isomeric SMILES

C=CCN(C1CCNCC1)C(=O)NCC2=CC(=CC=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C16H22N4O3.ClH/c1-2-10-19(14-6-8-17-9-7-14)16(21)18-12-13-4-3-5-15(11-13)20(22)23;/h2-5,11,14,17H,1,6-10,12H2,(H,18,21);1H