[(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-nitrophenyl)methanone Openeye Name: [(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-nitrophenyl)methanone CAS Name: [(2R)-2-(4-methoxyphenyl)-1-azepanyl]-(4-nitrophenyl)methanone IUPAC Name: [(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-nitrophenyl)methanone Traditional Name: [(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-nitrophenyl)methanone Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O4/c1-26-18-12-8-15(9-13-18)19-5-3-2-4-14-21(19)20(23)16-6-10-17(11-7-16)22(24)25/h6-13,19H,2-5,14H2,1H3/t19-/m1/s1