[1-(naphthalen-2-ylmethyl)piperidin-3-yl]methyl N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]carbamate

Systemtic Name: [1-(naphthalen-2-ylmethyl)piperidin-3-yl]methyl N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]carbamate Openeye Name: [1-(2-naphthylmethyl)-3-piperidyl]methyl N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]carbamate CAS Name: N-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]carbamic acid [1-(2-naphthalenylmethyl)-3-piperidinyl]methyl ester IUPAC Name: [1-(naphthalen-2-ylmethyl)piperidin-3-yl]methyl N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamate Traditional Name: N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]carbamic acid [1-(2-naphthylmethyl)-3-piperidyl]methyl ester Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCNC(=O)OCC2CCCN(C2)CC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCNC(=O)OCC2CCCN(C2)CC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H29N5O4/c1-18-26-14-23(29(31)32)28(18)12-10-25-24(30)33-17-20-5-4-11-27(16-20)15-19-8-9-21-6-2-3-7-22(21)13-19/h2-3,6-9,13-14,20H,4-5,10-12,15-17H2,1H3,(H,25,30)