(2R,5aR)-8-chloranyl-10-cyclopropyl-2-methyl-2,3,4,5,5a,6-hexahydro-1H-[1,4]diazepino[1,7-a]quinazolin-7-one

Systemtic Name: (2R,5aR)-8-chloranyl-10-cyclopropyl-2-methyl-2,3,4,5,5a,6-hexahydro-1H-[1,4]diazepino[1,7-a]quinazolin-7-one Openeye Name: (2R,5aR)-8-chloro-10-cyclopropyl-2-methyl-2,3,4,5,5a,6-hexahydro-1H-[1,4]diazepino[1,7-a]quinazolin-7-one CAS Name: (2R,5aR)-8-chloro-10-cyclopropyl-2-methyl-2,3,4,5,5a,6-hexahydro-1H-[1,4]diazepino[1,7-a]quinazolin-7-one IUPAC Name: (2R,5aR)-8-chloro-10-cyclopropyl-2-methyl-2,3,4,5,5a,6-hexahydro-1H-[1,4]diazepino[1,7-a]quinazolin-7-one Traditional Name: (2R,5aR)-8-chloro-10-cyclopropyl-2-methyl-2,3,4,5,5a,6-hexahydro-1H-[1,4]diazepino[1,7-a]quinazolin-7-one Formula: C16H20ClN3O MolecularWeight: 305.8025

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN2C(CCN1)NC(=O)C3=C2C=C(C=C3Cl)C4CC4

Isomeric SMILES

C[C@@H]1CN2[C@H](CCN1)NC(=O)C3=C2C=C(C=C3Cl)C4CC4

InChI

InChI=1S/C16H20ClN3O/c1-9-8-20-13-7-11(10-2-3-10)6-12(17)15(13)16(21)19-14(20)4-5-18-9/h6-7,9-10,14,18H,2-5,8H2,1H3,(H,19,21)/t9-,14-/m1/s1