4-(10-butyl-20-hexyl-15-pentan-3-yl-21,22-dihydroporphyrin-5-yl)-N,N-dimethyl-aniline

Systemtic Name: 4-(10-butyl-20-hexyl-15-pentan-3-yl-21,22-dihydroporphyrin-5-yl)-N,N-dimethyl-aniline Openeye Name: 4-[10-butyl-15-(1-ethylpropyl)-20-hexyl-21,22-dihydroporphyrin-5-yl]-N,N-dimethyl-aniline CAS Name: 4-(10-butyl-20-hexyl-15-pentan-3-yl-21,22-dihydroporphyrin-5-yl)-N,N-dimethylaniline IUPAC Name: 4-(10-butyl-20-hexyl-15-pentan-3-yl-21,22-dihydroporphyrin-5-yl)-N,N-dimethylaniline Traditional Name: [4-[10-butyl-15-(1-ethylpropyl)-20-hexyl-21,22-dihydroporphin-5-yl]phenyl]-dimethyl-amine Formula: C43H53N5 MolecularWeight: 639.91442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C=CC(=N2)C(=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C1N5)C6=CC=C(C=C6)N(C)C)N4)CCCC)C(CC)CC

Isomeric SMILES

CCCCCCC1=C2C=CC(=N2)C(=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C1N5)C6=CC=C(C=C6)N(C)C)N4)CCCC)C(CC)CC

InChI

InChI=1S/C43H53N5/c1-7-11-13-14-16-33-36-22-26-39(45-36)42(29(9-3)10-4)38-25-21-34(44-38)32(15-12-8-2)35-23-27-40(46-35)43(41-28-24-37(33)47-41)30-17-19-31(20-18-30)48(5)6/h17-29,46-47H,7-16H2,1-6H3