4-(phenylcarbonyl)-N-prop-2-ynyl-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(phenylcarbonyl)-N-prop-2-ynyl-1,4-diazepane-1-carboxamide Openeye Name: 4-benzoyl-N-prop-2-ynyl-1,4-diazepane-1-carboxamide CAS Name: 4-benzoyl-N-prop-2-ynyl-1,4-diazepane-1-carboxamide IUPAC Name: 4-benzoyl-N-prop-2-ynyl-1,4-diazepane-1-carboxamide Traditional Name: 4-benzoyl-N-propargyl-1,4-diazepane-1-carboxamide Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)N1CCCN(CC1)C(=O)C2=CC=CC=C2

Isomeric SMILES

C#CCNC(=O)N1CCCN(CC1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H19N3O2/c1-2-9-17-16(21)19-11-6-10-18(12-13-19)15(20)14-7-4-3-5-8-14/h1,3-5,7-8H,6,9-13H2,(H,17,21)