1-(2-naphthalen-1-ylethanoyl)-4-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-5-one

Systemtic Name: 1-(2-naphthalen-1-ylethanoyl)-4-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-5-one Openeye Name: 1-[2-(1-naphthyl)acetyl]-4-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-5-one CAS Name: 1-[2-(1-naphthalenyl)-1-oxoethyl]-4-[2-(1-pyrrolidin-1-iumyl)ethyl]-1,4-diazepan-5-one IUPAC Name: 1-(2-naphthalen-1-ylacetyl)-4-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-5-one Traditional Name: 1-[2-(1-naphthyl)acetyl]-4-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-5-one Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCN2CCN(CCC2=O)C(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)CCN2CCN(CCC2=O)C(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H29N3O2/c27-22-10-13-25(16-17-26(22)15-14-24-11-3-4-12-24)23(28)18-20-8-5-7-19-6-1-2-9-21(19)20/h1-2,5-9H,3-4,10-18H2/p+1