1-(2-chloranyl-4-pyrrolidin-1-yl-phenyl)carbonyl-4-(2-methoxyethyl)-2,5-dihydro-1,4-benzodiazepin-3-one

Systemtic Name: 1-(2-chloranyl-4-pyrrolidin-1-yl-phenyl)carbonyl-4-(2-methoxyethyl)-2,5-dihydro-1,4-benzodiazepin-3-one Openeye Name: 1-(2-chloro-4-pyrrolidin-1-yl-benzoyl)-4-(2-methoxyethyl)-2,5-dihydro-1,4-benzodiazepin-3-one CAS Name: 1-[[2-chloro-4-(1-pyrrolidinyl)phenyl]-oxomethyl]-4-(2-methoxyethyl)-2,5-dihydro-1,4-benzodiazepin-3-one IUPAC Name: 1-(2-chloro-4-pyrrolidin-1-ylbenzoyl)-4-(2-methoxyethyl)-2,5-dihydro-1,4-benzodiazepin-3-one Traditional Name: 1-(2-chloro-4-pyrrolidino-benzoyl)-4-(2-methoxyethyl)-2,5-dihydro-1,4-benzodiazepin-3-one Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CC2=CC=CC=C2N(CC1=O)C(=O)C3=C(C=C(C=C3)N4CCCC4)Cl

Isomeric SMILES

COCCN1CC2=CC=CC=C2N(CC1=O)C(=O)C3=C(C=C(C=C3)N4CCCC4)Cl

InChI

InChI=1S/C23H26ClN3O3/c1-30-13-12-26-15-17-6-2-3-7-21(17)27(16-22(26)28)23(29)19-9-8-18(14-20(19)24)25-10-4-5-11-25/h2-3,6-9,14H,4-5,10-13,15-16H2,1H3