2,6-bis(azanyl)hexanoic acid; N-(4-methanoylphenyl)ethanamide; (3-methoxyphenyl)methanamine

Systemtic Name: 2,6-bis(azanyl)hexanoic acid; N-(4-methanoylphenyl)ethanamide; (3-methoxyphenyl)methanamine Openeye Name: 2,6-diaminohexanoic acid; N-(4-formylphenyl)acetamide; (3-methoxyphenyl)methanamine CAS Name: 2,6-diaminohexanoic acid; N-(4-formylphenyl)acetamide; (3-methoxyphenyl)methanamine IUPAC Name: 2,6-diaminohexanoic acid; N-(4-formylphenyl)acetamide; (3-methoxyphenyl)methanamine Traditional Name: 2,6-diaminohexanoic acid; N-(4-formylphenyl)acetamide; m-anisylamine Formula: C23H34N4O5 MolecularWeight: 446.53986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C=O.COC1=CC=CC(=C1)CN.C(CCN)CC(C(=O)O)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C=O.COC1=CC=CC(=C1)CN.C(CCN)CC(C(=O)O)N

InChI

InChI=1S/C9H9NO2.C8H11NO.C6H14N2O2/c1-7(12)10-9-4-2-8(6-11)3-5-9;1-10-8-4-2-3-7(5-8)6-9;7-4-2-1-3-5(8)6(9)10/h2-6H,1H3,(H,10,12);2-5H,6,9H2,1H3;5H,1-4,7-8H2,(H,9,10)