N-[(1-methanidyl-6-naphthalen-1-yl-pyridin-1-ium-2-yl)-phenanthren-9-yl-methyl]-2,6-di(propan-2-yl)aniline

Systemtic Name: N-[(1-methanidyl-6-naphthalen-1-yl-pyridin-1-ium-2-yl)-phenanthren-9-yl-methyl]-2,6-di(propan-2-yl)aniline Openeye Name: 2,6-diisopropyl-N-[[1-methanidyl-6-(1-naphthyl)pyridin-1-ium-2-yl]-(9-phenanthryl)methyl]aniline CAS Name: N-[[1-methanidyl-6-(1-naphthalenyl)-2-pyridin-1-iumyl]-(9-phenanthrenyl)methyl]-2,6-di(propan-2-yl)aniline IUPAC Name: N-[(1-methanidyl-6-naphthalen-1-ylpyridin-1-ium-2-yl)-phenanthren-9-ylmethyl]-2,6-di(propan-2-yl)aniline Traditional Name: (2,6-diisopropylphenyl)-[[1-methanidyl-6-(1-naphthyl)pyridin-1-ium-2-yl]-(9-phenanthryl)methyl]amine Formula: C43H40N2 MolecularWeight: 584.7911

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(C2=CC=CC(=[N+]2[CH2-])C3=CC=CC4=CC=CC=C43)C5=CC6=CC=CC=C6C7=CC=CC=C75

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(C2=CC=CC(=[N+]2[CH2-])C3=CC=CC4=CC=CC=C43)C5=CC6=CC=CC=C6C7=CC=CC=C75

InChI

InChI=1S/C43H40N2/c1-28(2)32-22-13-23-33(29(3)4)42(32)44-43(39-27-31-16-7-9-19-35(31)36-20-10-11-21-37(36)39)41-26-14-25-40(45(41)5)38-24-12-17-30-15-6-8-18-34(30)38/h6-29,43-44H,5H2,1-4H3