carbamimidoyl-[2,6-diethoxy-3,5-bis(phenylmethoxy)phenyl]-methanoyl-methyl-azanium

Systemtic Name: carbamimidoyl-[2,6-diethoxy-3,5-bis(phenylmethoxy)phenyl]-methanoyl-methyl-azanium Openeye Name: carbamimidoyl-(3,5-dibenzyloxy-2,6-diethoxy-phenyl)-formyl-methyl-ammonium CAS Name: carbamimidoyl-[2,6-diethoxy-3,5-bis(phenylmethoxy)phenyl]-formyl-methylammonium IUPAC Name: carbamimidoyl-[2,6-diethoxy-3,5-bis(phenylmethoxy)phenyl]-formyl-methylazanium Traditional Name: amidino-(3,5-dibenzoxy-2,6-diethoxy-phenyl)-formyl-methyl-ammonium Formula: C27H32N3O5+ MolecularWeight: 478.56008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C=C1OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC)[N+](C)(C=O)C(=N)N

Isomeric SMILES

CCOC1=C(C(=C(C=C1OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC)[N+](C)(C=O)C(=N)N

InChI

InChI=1S/C27H32N3O5/c1-4-32-25-22(34-17-20-12-8-6-9-13-20)16-23(35-18-21-14-10-7-11-15-21)26(33-5-2)24(25)30(3,19-31)27(28)29/h6-16,19H,4-5,17-18H2,1-3H3,(H3,28,29)/q+1