3-azanyl-5-(2,2-diethoxyethyl)-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 3-azanyl-5-(2,2-diethoxyethyl)-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 3-amino-1-benzoyl-5-(2,2-diethoxyethyl)-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 3-amino-1-benzoyl-5-(2,2-diethoxyethyl)-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 3-amino-1-benzoyl-5-(2,2-diethoxyethyl)-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 3-amino-1-benzoyl-5-(2,2-diethoxyethyl)-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C2=CC=CC=C2N(CC(C1=O)N)C(=O)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOC(CN1C2=CC=CC=C2N(CC(C1=O)N)C(=O)C3=CC=CC=C3)OCC

InChI

InChI=1S/C22H27N3O4/c1-3-28-20(29-4-2)15-25-19-13-9-8-12-18(19)24(14-17(23)22(25)27)21(26)16-10-6-5-7-11-16/h5-13,17,20H,3-4,14-15,23H2,1-2H3