3-[(3S)-7-chloranyl-1-ethyl-2,5-bis(oxidanylidene)-3,4-dihydro-1,4-benzodiazepin-3-yl]propanamide

Systemtic Name: 3-[(3S)-7-chloranyl-1-ethyl-2,5-bis(oxidanylidene)-3,4-dihydro-1,4-benzodiazepin-3-yl]propanamide Openeye Name: 3-[(3S)-7-chloro-1-ethyl-2,5-dioxo-3,4-dihydro-1,4-benzodiazepin-3-yl]propanamide CAS Name: 3-[(3S)-7-chloro-1-ethyl-2,5-dioxo-3,4-dihydro-1,4-benzodiazepin-3-yl]propanamide IUPAC Name: 3-[(3S)-7-chloro-1-ethyl-2,5-dioxo-3,4-dihydro-1,4-benzodiazepin-3-yl]propanamide Traditional Name: 3-[(3S)-7-chloro-1-ethyl-2,5-diketo-3,4-dihydro-1,4-benzodiazepin-3-yl]propionamide Formula: C14H16ClN3O3 MolecularWeight: 309.74814

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Cl)C(=O)NC(C1=O)CCC(=O)N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Cl)C(=O)N[C@H](C1=O)CCC(=O)N

InChI

InChI=1S/C14H16ClN3O3/c1-2-18-11-5-3-8(15)7-9(11)13(20)17-10(14(18)21)4-6-12(16)19/h3,5,7,10H,2,4,6H2,1H3,(H2,16,19)(H,17,20)/t10-/m0/s1