5-[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]-2,2-diethyl-acenaphthylen-1-one

Systemtic Name: 5-[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]-2,2-diethyl-acenaphthylen-1-one Openeye Name: 5-[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]-2,2-diethyl-acenaphthylen-1-one CAS Name: 5-[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]-2,2-diethyl-1-acenaphthylenone IUPAC Name: 5-[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]-2,2-diethylacenaphthylen-1-one Traditional Name: 5-[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]-2,2-diethyl-acenaphthen-1-one Formula: C25H32N2O MolecularWeight: 376.53438

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C3C(=C(C=C2)N4CCCN(CC4)CC5CC5)C=CC=C3C1=O)CC

Isomeric SMILES

CCC1(C2=C3C(=C(C=C2)N4CCCN(CC4)CC5CC5)C=CC=C3C1=O)CC

InChI

InChI=1S/C25H32N2O/c1-3-25(4-2)21-11-12-22(19-7-5-8-20(23(19)21)24(25)28)27-14-6-13-26(15-16-27)17-18-9-10-18/h5,7-8,11-12,18H,3-4,6,9-10,13-17H2,1-2H3