tert-butyl 4-[3-[azanyl(methyl)carbamoyl]oxyphenoxy]benzoate; hexan-1-amine

Systemtic Name: tert-butyl 4-[3-[azanyl(methyl)carbamoyl]oxyphenoxy]benzoate; hexan-1-amine Openeye Name: tert-butyl 4-[3-[amino(methyl)carbamoyl]oxyphenoxy]benzoate; hexan-1-amine CAS Name: 4-[3-[[amino(methyl)amino]-oxomethoxy]phenoxy]benzoic acid tert-butyl ester; 1-hexanamine IUPAC Name: tert-butyl 4-[3-[amino(methyl)carbamoyl]oxyphenoxy]benzoate; hexan-1-amine Traditional Name: 4-[3-[amino(methyl)carbamoyl]oxyphenoxy]benzoic acid tert-butyl ester; hexylamine Formula: C25H37N3O5 MolecularWeight: 459.57838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN.CC(C)(C)OC(=O)C1=CC=C(C=C1)OC2=CC(=CC=C2)OC(=O)N(C)N

Isomeric SMILES

CCCCCCN.CC(C)(C)OC(=O)C1=CC=C(C=C1)OC2=CC(=CC=C2)OC(=O)N(C)N

InChI

InChI=1S/C19H22N2O5.C6H15N/c1-19(2,3)26-17(22)13-8-10-14(11-9-13)24-15-6-5-7-16(12-15)25-18(23)21(4)20;1-2-3-4-5-6-7/h5-12H,20H2,1-4H3;2-7H2,1H3