2-[[4-[(4-aminophenyl)methyl]phenyl]amino]-3-piperidin-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-[[4-[(4-aminophenyl)methyl]phenyl]amino]-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-[4-[(4-aminophenyl)methyl]anilino]-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-[4-[(4-aminophenyl)methyl]anilino]-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-[4-[(4-aminophenyl)methyl]anilino]-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-[4-(4-aminobenzyl)anilino]-3-piperidino-1,4-naphthoquinone Formula: C28H27N3O2 MolecularWeight: 437.53288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)CC5=CC=C(C=C5)N

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)CC5=CC=C(C=C5)N

InChI

InChI=1S/C28H27N3O2/c29-21-12-8-19(9-13-21)18-20-10-14-22(15-11-20)30-25-26(31-16-4-1-5-17-31)28(33)24-7-3-2-6-23(24)27(25)32/h2-3,6-15,30H,1,4-5,16-18,29H2