[7-chloranyl-2-(ethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ethanoate

Systemtic Name: [7-chloranyl-2-(ethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ethanoate Openeye Name: [7-chloro-2-(ethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] acetate CAS Name: acetic acid [7-chloro-2-(ethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ester IUPAC Name: [7-chloro-2-(ethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] acetate Traditional Name: acetic acid [7-chloro-2-(ethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ester Formula: C19H18ClN3O2 MolecularWeight: 355.81812

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=C(C=C(C=C2)Cl)C(=NC1OC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CCNC1=NC2=C(C=C(C=C2)Cl)C(=NC1OC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C19H18ClN3O2/c1-3-21-18-19(25-12(2)24)23-17(13-7-5-4-6-8-13)15-11-14(20)9-10-16(15)22-18/h4-11,19H,3H2,1-2H3,(H,21,22)