N-(4-methylphenyl)-N-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]phenyl]pyren-1-amine

Systemtic Name: N-(4-methylphenyl)-N-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]phenyl]pyren-1-amine Openeye Name: N-[4-[4-[3-(1-piperidyl)propoxy]phenyl]phenyl]-N-(p-tolyl)pyren-1-amine CAS Name: N-(4-methylphenyl)-N-[4-[4-[3-(1-piperidinyl)propoxy]phenyl]phenyl]-1-pyrenamine IUPAC Name: N-(4-methylphenyl)-N-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]phenyl]pyren-1-amine Traditional Name: [4-[4-(3-piperidinopropoxy)phenyl]phenyl]-(p-tolyl)-pyren-1-yl-amine Formula: C43H40N2O MolecularWeight: 600.7905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCN4CCCCC4)C5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCN4CCCCC4)C5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5

InChI

InChI=1S/C43H40N2O/c1-31-9-19-37(20-10-31)45(41-26-18-36-12-11-34-7-5-8-35-17-25-40(41)43(36)42(34)35)38-21-13-32(14-22-38)33-15-23-39(24-16-33)46-30-6-29-44-27-3-2-4-28-44/h5,7-26H,2-4,6,27-30H2,1H3