N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-nitro-4-phenylazanyl-benzamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-nitro-4-phenylazanyl-benzamide Openeye Name: 4-anilino-N-[(4S)-chroman-4-yl]-3-nitro-benzamide CAS Name: 4-anilino-N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-3-nitrobenzamide IUPAC Name: 4-anilino-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-nitrobenzamide Traditional Name: 4-anilino-N-[(4S)-chroman-4-yl]-3-nitro-benzamide Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=CC=CC=C2[C@H]1NC(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4/c26-22(24-18-12-13-29-21-9-5-4-8-17(18)21)15-10-11-19(20(14-15)25(27)28)23-16-6-2-1-3-7-16/h1-11,14,18,23H,12-13H2,(H,24,26)/t18-/m0/s1