1-[4-(2-methylpropylamino)cyclohepta[b]indol-7-yl]butan-1-one

Systemtic Name: 1-[4-(2-methylpropylamino)cyclohepta[b]indol-7-yl]butan-1-one Openeye Name: 1-[4-(isobutylamino)cyclohepta[b]indol-7-yl]butan-1-one CAS Name: 1-[4-(2-methylpropylamino)-7-cyclohepta[b]indolyl]-1-butanone IUPAC Name: 1-[4-(2-methylpropylamino)cyclohepta[b]indol-7-yl]butan-1-one Traditional Name: 1-[4-(isobutylamino)cyclohept[b]indol-7-yl]butan-1-one Formula: C21H24N2O MolecularWeight: 320.42806

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=CC2=C3C=CC=C(C3=NC2=C1)NCC(C)C

Isomeric SMILES

CCCC(=O)C1=CC=CC2=C3C=CC=C(C3=NC2=C1)NCC(C)C

InChI

InChI=1S/C21H24N2O/c1-4-7-20(24)15-8-5-9-16-17-10-6-11-18(22-13-14(2)3)21(17)23-19(16)12-15/h5-6,8-12,14,22H,4,7,13H2,1-3H3