1-ethyl-5-(2-piperidin-1-ium-1-ylethyl)-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 1-ethyl-5-(2-piperidin-1-ium-1-ylethyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-ethyl-5-(2-piperidin-1-ium-1-ylethyl)-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-ethyl-5-[2-(1-piperidin-1-iumyl)ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-ethyl-5-(2-piperidin-1-ium-1-ylethyl)-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-ethyl-5-(2-piperidin-1-ium-1-ylethyl)-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C18H28N3O+ MolecularWeight: 302.43442

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(=O)N(C2=CC=CC=C21)CC[NH+]3CCCCC3

Isomeric SMILES

CCN1CCC(=O)N(C2=CC=CC=C21)CC[NH+]3CCCCC3

InChI

InChI=1S/C18H27N3O/c1-2-20-13-10-18(22)21(17-9-5-4-8-16(17)20)15-14-19-11-6-3-7-12-19/h4-5,8-9H,2-3,6-7,10-15H2,1H3/p+1