actinium; 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-piperidin-1-id-4-yl-butan-1-one

Systemtic Name: actinium; 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-piperidin-1-id-4-yl-butan-1-one Openeye Name: actinium; 1-[3-(o-tolylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-piperidin-1-id-4-yl-butan-1-one CAS Name: actinium; 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-(4-piperidin-1-idyl)-1-butanone IUPAC Name: actinium; 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-piperidin-1-id-4-ylbutan-1-one Traditional Name: actinium; 1-[3-(2-methylbenzyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-piperidin-1-id-4-yl-butan-1-one Formula: C27H35AcN2O- MolecularWeight: 630.607347

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCC3=C(CC2)C=C(C=C3)C(=O)CCCC4CC[N-]CC4.[Ac]

Isomeric SMILES

CC1=CC=CC=C1CN2CCC3=C(CC2)C=C(C=C3)C(=O)CCCC4CC[N-]CC4.[Ac]

InChI

InChI=1S/C27H35N2O.Ac/c1-21-5-2-3-7-26(21)20-29-17-13-23-9-10-25(19-24(23)14-18-29)27(30)8-4-6-22-11-15-28-16-12-22;/h2-3,5,7,9-10,19,22H,4,6,8,11-18,20H2,1H3;/q-1;