4-(2-chloroethyl)-2-methyl-8-nitro-4,5-dihydro-3H-2-benzazepin-1-one hydrochloride

Systemtic Name: 4-(2-chloroethyl)-2-methyl-8-nitro-4,5-dihydro-3H-2-benzazepin-1-one hydrochloride Openeye Name: 4-(2-chloroethyl)-2-methyl-8-nitro-4,5-dihydro-3H-2-benzazepin-1-one hydrochloride CAS Name: 4-(2-chloroethyl)-2-methyl-8-nitro-4,5-dihydro-3H-2-benzazepin-1-one hydrochloride IUPAC Name: 4-(2-chloroethyl)-2-methyl-8-nitro-4,5-dihydro-3H-2-benzazepin-1-one hydrochloride Traditional Name: 4-(2-chloroethyl)-2-methyl-8-nitro-4,5-dihydro-3H-2-benzazepin-1-one hydrochloride Formula: C13H16Cl2N2O3 MolecularWeight: 319.18374

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])CCCl.Cl

Isomeric SMILES

CN1CC(CC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])CCCl.Cl

InChI

InChI=1S/C13H15ClN2O3.ClH/c1-15-8-9(4-5-14)6-10-2-3-11(16(18)19)7-12(10)13(15)17;/h2-3,7,9H,4-6,8H2,1H3;1H