1-[(2-methyl-1H-indol-3-yl)methyl]-4-propyl-1,4-diazepan-1-ium-5-one

Systemtic Name: 1-[(2-methyl-1H-indol-3-yl)methyl]-4-propyl-1,4-diazepan-1-ium-5-one Openeye Name: 1-[(2-methyl-1H-indol-3-yl)methyl]-4-propyl-1,4-diazepan-1-ium-5-one CAS Name: 1-[(2-methyl-1H-indol-3-yl)methyl]-4-propyl-1,4-diazepan-1-ium-5-one IUPAC Name: 1-[(2-methyl-1H-indol-3-yl)methyl]-4-propyl-1,4-diazepan-1-ium-5-one Traditional Name: 1-[(2-methyl-1H-indol-3-yl)methyl]-4-propyl-1,4-diazepan-1-ium-5-one Formula: C18H26N3O+ MolecularWeight: 300.41854

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC[NH+](CCC1=O)CC2=C(NC3=CC=CC=C32)C

Isomeric SMILES

CCCN1CC[NH+](CCC1=O)CC2=C(NC3=CC=CC=C32)C

InChI

InChI=1S/C18H25N3O/c1-3-9-21-12-11-20(10-8-18(21)22)13-16-14(2)19-17-7-5-4-6-15(16)17/h4-7,19H,3,8-13H2,1-2H3/p+1