2-(2-chloroethyl)-4-methyl-7-nitro-2,3-dihydro-1,4-benzoxazepine-5-thione

Systemtic Name: 2-(2-chloroethyl)-4-methyl-7-nitro-2,3-dihydro-1,4-benzoxazepine-5-thione Openeye Name: 2-(2-chloroethyl)-4-methyl-7-nitro-2,3-dihydro-1,4-benzoxazepine-5-thione CAS Name: 2-(2-chloroethyl)-4-methyl-7-nitro-2,3-dihydro-1,4-benzoxazepine-5-thione IUPAC Name: 2-(2-chloroethyl)-4-methyl-7-nitro-2,3-dihydro-1,4-benzoxazepine-5-thione Traditional Name: 2-(2-chloroethyl)-4-methyl-7-nitro-2,3-dihydro-1,4-benzoxazepine-5-thione Formula: C12H13ClN2O3S MolecularWeight: 300.76122

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(OC2=C(C1=S)C=C(C=C2)[N+](=O)[O-])CCCl

Isomeric SMILES

CN1CC(OC2=C(C1=S)C=C(C=C2)[N+](=O)[O-])CCCl

InChI

InChI=1S/C12H13ClN2O3S/c1-14-7-9(4-5-13)18-11-3-2-8(15(16)17)6-10(11)12(14)19/h2-3,6,9H,4-5,7H2,1H3