7-cycloheptyl-1-(phenylmethyl)-4-(2-piperazin-1-ylethyl)indole-2,3-dione

Systemtic Name: 7-cycloheptyl-1-(phenylmethyl)-4-(2-piperazin-1-ylethyl)indole-2,3-dione Openeye Name: 1-benzyl-7-cycloheptyl-4-(2-piperazin-1-ylethyl)indoline-2,3-dione CAS Name: 7-cycloheptyl-1-(phenylmethyl)-4-[2-(1-piperazinyl)ethyl]indole-2,3-dione IUPAC Name: 1-benzyl-7-cycloheptyl-4-(2-piperazin-1-ylethyl)indole-2,3-dione Traditional Name: 1-benzyl-7-cycloheptyl-4-(2-piperazinoethyl)isatin Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C2=C3C(=C(C=C2)CCN4CCNCC4)C(=O)C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

C1CCCC(CC1)C2=C3C(=C(C=C2)CCN4CCNCC4)C(=O)C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C28H35N3O2/c32-27-25-23(14-17-30-18-15-29-16-19-30)12-13-24(22-10-6-1-2-7-11-22)26(25)31(28(27)33)20-21-8-4-3-5-9-21/h3-5,8-9,12-13,22,29H,1-2,6-7,10-11,14-20H2