[4-[2-[4-(aminomethyl)piperidin-1-yl]ethyl]phenyl] acridine-9-carboxylate

Systemtic Name: [4-[2-[4-(aminomethyl)piperidin-1-yl]ethyl]phenyl] acridine-9-carboxylate Openeye Name: [4-[2-[4-(aminomethyl)-1-piperidyl]ethyl]phenyl] acridine-9-carboxylate CAS Name: 9-acridinecarboxylic acid [4-[2-[4-(aminomethyl)-1-piperidinyl]ethyl]phenyl] ester IUPAC Name: [4-[2-[4-(aminomethyl)piperidin-1-yl]ethyl]phenyl] acridine-9-carboxylate Traditional Name: acridine-9-carboxylic acid [4-[2-[4-(aminomethyl)piperidino]ethyl]phenyl] ester Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)CCC2=CC=C(C=C2)OC(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53

Isomeric SMILES

C1CN(CCC1CN)CCC2=CC=C(C=C2)OC(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53

InChI

InChI=1S/C28H29N3O2/c29-19-21-14-17-31(18-15-21)16-13-20-9-11-22(12-10-20)33-28(32)27-23-5-1-3-7-25(23)30-26-8-4-2-6-24(26)27/h1-12,21H,13-19,29H2