ethyl 3-[[(R)-cyclopropyl(phenyl)methyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[(R)-cyclopropyl(phenyl)methyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[(R)-cyclopropyl(phenyl)methyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(R)-cyclopropyl(phenyl)methyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[(R)-cyclopropyl(phenyl)methyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(R)-cyclopropyl(phenyl)methyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC(C2CC2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N[C@H](C2CC2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O5/c1-2-27-20(24)16-10-15(11-17(12-16)22(25)26)19(23)21-18(14-8-9-14)13-6-4-3-5-7-13/h3-7,10-12,14,18H,2,8-9H2,1H3,(H,21,23)/t18-/m0/s1