N-[4,7-bis(azanyl)heptan-2-yl]-9-methyl-phenazine-1-carboxamide

Systemtic Name: N-[4,7-bis(azanyl)heptan-2-yl]-9-methyl-phenazine-1-carboxamide Openeye Name: N-(3,6-diamino-1-methyl-hexyl)-9-methyl-phenazine-1-carboxamide CAS Name: N-(4,7-diaminoheptan-2-yl)-9-methyl-1-phenazinecarboxamide IUPAC Name: N-(4,7-diaminoheptan-2-yl)-9-methylphenazine-1-carboxamide Traditional Name: N-(3,6-diamino-1-methyl-hexyl)-9-methyl-phenazine-1-carboxamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC3=CC=CC(=C3N=C12)C(=O)NC(C)CC(CCCN)N

Isomeric SMILES

CC1=CC=CC2=NC3=CC=CC(=C3N=C12)C(=O)NC(C)CC(CCCN)N

InChI

InChI=1S/C21H27N5O/c1-13-6-3-9-17-19(13)26-20-16(8-4-10-18(20)25-17)21(27)24-14(2)12-15(23)7-5-11-22/h3-4,6,8-10,14-15H,5,7,11-12,22-23H2,1-2H3,(H,24,27)