N-[(2S)-1-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(2S)-1-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1S)-2-[[(4S)-chroman-4-yl]amino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[(2S)-1-[[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2S)-1-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1S)-2-[[(4S)-chroman-4-yl]amino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCOC2=CC=CC=C12)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)N[C@H]1CCOC2=CC=CC=C12)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c1-12(20-19(24)13-5-4-6-14(11-13)22(25)26)18(23)21-16-9-10-27-17-8-3-2-7-15(16)17/h2-8,11-12,16H,9-10H2,1H3,(H,20,24)(H,21,23)/t12-,16-/m0/s1