8,12-diethyl-7,13-dimethyl-23,24-dihydro-22H-corrin-5-carbaldehyde

Systemtic Name: 8,12-diethyl-7,13-dimethyl-23,24-dihydro-22H-corrin-5-carbaldehyde Openeye Name: 8,12-diethyl-7,13-dimethyl-23,24-dihydro-22H-corrin-5-carbaldehyde CAS Name: 8,12-diethyl-7,13-dimethyl-23,24-dihydro-22H-corrin-5-carboxaldehyde IUPAC Name: 8,12-diethyl-7,13-dimethyl-23,24-dihydro-22H-corrin-5-carbaldehyde Traditional Name: 8,12-diethyl-7,13-dimethyl-23,24-dihydro-22H-corrin-5-carbaldehyde Formula: C26H26N4O MolecularWeight: 410.51084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=C3C(=C(C(=C(C4=NC(=C5C=CC(=CC(=C1C)N2)N5)C=C4)C=O)N3)C)CC

Isomeric SMILES

CCC1=C2C=C3C(=C(C(=C(C4=NC(=C5C=CC(=CC(=C1C)N2)N5)C=C4)C=O)N3)C)CC

InChI

InChI=1S/C26H26N4O/c1-5-17-14(3)23-11-16-7-8-21(27-16)22-10-9-20(28-22)19(13-31)26-15(4)18(6-2)25(30-26)12-24(17)29-23/h7-13,27,29-30H,5-6H2,1-4H3