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

Systemtic Name: 4-chloranyl-N-[(2S)-1-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-2-[[(4S)-chroman-4-yl]amino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-[[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-2-[[(4S)-chroman-4-yl]amino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C19H18ClN3O5 MolecularWeight: 403.81632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClN3O5/c1-11(21-19(25)12-6-7-14(20)16(10-12)23(26)27)18(24)22-15-8-9-28-17-5-3-2-4-13(15)17/h2-7,10-11,15H,8-9H2,1H3,(H,21,25)(H,22,24)/t11-,15-/m0/s1