N-(cyclopropylmethyl)-4-(4-methoxyphenyl)carbonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-4-(4-methoxyphenyl)carbonyl-1,4-diazepane-1-carboxamide Openeye Name: N-(cyclopropylmethyl)-4-(4-methoxybenzoyl)-1,4-diazepane-1-carboxamide CAS Name: N-(cyclopropylmethyl)-4-[(4-methoxyphenyl)-oxomethyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(cyclopropylmethyl)-4-(4-methoxybenzoyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(cyclopropylmethyl)-4-p-anisoyl-1,4-diazepane-1-carboxamide Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)NCC3CC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)NCC3CC3

InChI

InChI=1S/C18H25N3O3/c1-24-16-7-5-15(6-8-16)17(22)20-9-2-10-21(12-11-20)18(23)19-13-14-3-4-14/h5-8,14H,2-4,9-13H2,1H3,(H,19,23)