ethyl 2-[[4-[3-(5-nitrofuran-2-yl)prop-2-enoylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[4-[3-(5-nitrofuran-2-yl)prop-2-enoylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[4-[3-(5-nitro-2-furyl)prop-2-enoylamino]piperidine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[4-[[3-(5-nitro-2-furanyl)-1-oxoprop-2-enyl]amino]-4-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-[3-(5-nitrofuran-2-yl)prop-2-enoylamino]piperidine-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[4-[[3-(5-nitro-2-furyl)acryloyl]amino]isonipecotoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C24H28N4O7 MolecularWeight: 484.50172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2(CCNCC2)NC(=O)C=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2(CCNCC2)NC(=O)C=CC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C24H28N4O7/c1-2-34-22(30)19(16-17-6-4-3-5-7-17)26-23(31)24(12-14-25-15-13-24)27-20(29)10-8-18-9-11-21(35-18)28(32)33/h3-11,19,25H,2,12-16H2,1H3,(H,26,31)(H,27,29)