2-chloranyl-3-[[1-(phenylmethyl)piperidin-4-yl]amino]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[[1-(phenylmethyl)piperidin-4-yl]amino]naphthalene-1,4-dione Openeye Name: 2-[(1-benzyl-4-piperidyl)amino]-3-chloro-naphthalene-1,4-dione CAS Name: 2-chloro-3-[[1-(phenylmethyl)-4-piperidinyl]amino]naphthalene-1,4-dione IUPAC Name: 2-[(1-benzylpiperidin-4-yl)amino]-3-chloronaphthalene-1,4-dione Traditional Name: 2-[(1-benzyl-4-piperidyl)amino]-3-chloro-1,4-naphthoquinone Formula: C22H21ClN2O2 MolecularWeight: 380.86734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H21ClN2O2/c23-19-20(22(27)18-9-5-4-8-17(18)21(19)26)24-16-10-12-25(13-11-16)14-15-6-2-1-3-7-15/h1-9,16,24H,10-14H2