ethyl 2-[[4-[3-(2-methyl-4-nitro-imidazol-1-yl)propanoylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[4-[3-(2-methyl-4-nitro-imidazol-1-yl)propanoylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[4-[3-(2-methyl-4-nitro-imidazol-1-yl)propanoylamino]piperidine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[4-[[3-(2-methyl-4-nitro-1-imidazolyl)-1-oxopropyl]amino]-4-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-[3-(2-methyl-4-nitroimidazol-1-yl)propanoylamino]piperidine-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[4-[3-(2-methyl-4-nitro-imidazol-1-yl)propanoylamino]isonipecotoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C24H32N6O6 MolecularWeight: 500.54748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2(CCNCC2)NC(=O)CCN3C=C(N=C3C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2(CCNCC2)NC(=O)CCN3C=C(N=C3C)[N+](=O)[O-]

InChI

InChI=1S/C24H32N6O6/c1-3-36-22(32)19(15-18-7-5-4-6-8-18)27-23(33)24(10-12-25-13-11-24)28-21(31)9-14-29-16-20(30(34)35)26-17(29)2/h4-8,16,19,25H,3,9-15H2,1-2H3,(H,27,33)(H,28,31)